diphenethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diphenethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diphenethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diphenethyl ester IUPAC Name: diphenethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diphenethyl ester Formula: C31H30N2O6 MolecularWeight: 526.5797

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C31H30N2O6/c1-21-27(30(34)38-18-16-23-10-5-3-6-11-23)29(25-14-9-15-26(20-25)33(36)37)28(22(2)32-21)31(35)39-19-17-24-12-7-4-8-13-24/h3-15,20,29,32H,16-19H2,1-2H3